SCHEMBL29931025

SCHEMBL29931025

C=C(C)C(CCC(C)(C)O)Cc1c(O)cc(OC)c2c1OC(c1ccc(O)cc1OC)CC2=O

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 9/20 0.91
▸ ESR1 P03372 4/20 0.69
▸ SLC5A1 P13866 2/20 0.69
▸ SLC5A2 P31639 2/20 0.69
▸ PTGS1 P23219 1/20 0.69
▸ SOAT1 P35610 1/20 0.69
▸ BCHE P06276 1/20 0.69
▸ ACHE P22303 1/20 0.69
▸ CACNA1G O43497 1/20 0.56
▸ CACNA1H O95180 1/20 0.56
▸ ABCG2 Q9UNQ0 1/20 0.56
▸ PDPK1 O15530 1/20 0.49
▸ PRKCA P17252 1/20 0.49
▸ PRKCQ Q04759 1/20 0.49
▸ AKR1B10 O60218 1/20 0.49
▸ AKR1B1 P15121 1/20 0.49
▸ ESR2 Q92731 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ IDO1 P14902 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Kurarinol SCHEMBL27013517 0.95 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
Kurarinol SCHEMBL29460259 0.95 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
Norkurarinol SCHEMBL29931052 0.87 BACE1 (0.84) BACE1ESR1SLC5A1SLC5A2PTGS1
Norkurarinol SCHEMBL15386075 0.87 BACE1 (0.84) BACE1ESR1SLC5A1SLC5A2PTGS1
SCHEMBL15452193 0.86 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
SCHEMBL15386077 0.86 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
SCHEMBL27013509 0.86 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
SCHEMBL31237251 0.86 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
Leachianone A SCHEMBL30766171 0.82 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1
Leachianone A SCHEMBL29415618 0.82 BACE1 (1.00) BACE1ESR1SLC5A1SLC5A2PTGS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120022223-A Ginseng and radix paeoniae alba acne-removing composition and application thereof 广州俪妍化妆品技术有限公司 2025-05-23 — — CN disclosed
CN-117122635-B Traditional Chinese medicine fumigation lotion for anorectal hemorrhoid diseases and preparation method thereof 济南市槐荫人民医院 2024-10-29 — — CN disclosed
CN-117122635-A Traditional Chinese medicine fumigation lotion for anorectal hemorrhoid diseases and preparation method thereof 济南市槐荫人民医院 2023-11-28 — — CN disclosed
CN-115300401-A Silver ion-containing itching-relieving, skin-tendering, skin-protecting, moisturizing and antibacterial compound and application thereof 广东正汇源实业有限公司 2022-11-08 — — CN disclosed
CN-115245476-A Composition for removing dandruff, relieving itching and improving scalp microenvironment and preparation method thereof 上海松皓生物科技有限公司 2022-10-28 — — CN disclosed
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